data_1zil_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1zil _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' ARG . . . . . 0.454 ' CA ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.171 0 N-CA-C 114.965 1.468 . . . . 73.040000000000006 114.965 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -50.87 71.55 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 124.853 1.261 . . . . 66.939999999999998 108.552 179.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -61.72 -17.98 57.9 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 113.637 -1.62 . . . . 56.219999999999999 110.225 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . 0.454 ' NE2' ' CA ' ' A' ' 1' ' ' ARG . 15.3 mt-30 -83.18 -40.84 19.17 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 106.186 -1.783 . . . . 100.0 106.186 179.231 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 16.6 mt -69.64 -37.31 76.73 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 114.649 -1.159 . . . . 24.199999999999999 109.171 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.86 -47.73 82.1 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 113.803 -1.544 . . . . 24.039999999999999 110.154 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.94 -27.78 69.08 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 115.532 1.679 . . . . 37.909999999999997 115.532 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -71.58 -41.61 68.81 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.972 -1.013 . . . . 35.670000000000002 109.688 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 13.8 t -62.64 -46.83 95.42 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 N-CA-C 108.294 -1.002 . . . . 24.48 108.294 179.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -62.58 -39.94 95.3 Favored 'General case' 0 CA--C 1.501 -0.907 0 CA-C-N 114.897 -1.047 . . . . 53.369999999999997 111.676 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 115.838 -2.345 . . . . 60.93 110.985 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.53 -24.33 64.63 Favored 'General case' 0 C--O 1.253 1.247 0 N-CA-C 115.611 1.708 . . . . 28.469999999999999 115.611 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.11 -39.5 68.82 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 120.056 -0.657 . . . . 28.640000000000001 109.597 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.85 -38.64 88.99 Favored 'General case' 0 C--N 1.352 0.701 0 CA-C-N 114.363 -1.289 . . . . 31.960000000000001 110.768 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.5 mttm -68.67 -47.8 65.57 Favored 'General case' 0 C--O 1.206 -1.203 0 N-CA-C 107.946 -1.131 . . . . 91.060000000000002 107.946 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . 0.455 ' NE2' ' OE2' ' A' ' 20' ' ' GLU . 31.8 tt0 -52.93 -49.37 66.14 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.09 -0.959 . . . . 29.18 111.392 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.259 22.0 m-85 -58.86 -48.39 81.52 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.122 1.156 . . . . 24.75 114.122 179.428 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -51.87 -46.79 64.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.927 0.87 . . . . 38.759999999999998 108.961 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.5 mt -57.51 -45.31 85.1 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 113.393 -1.731 . . . . 48.240000000000002 113.362 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . 0.455 ' OE2' ' NE2' ' A' ' 16' ' ' GLN . 30.6 mt-10 -70.76 -31.5 68.32 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 118.636 -1.226 . . . . 80.019999999999996 110.798 -179.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -61.81 -49.06 77.86 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 118.258 -1.377 . . . . 45.119999999999997 109.64 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' OE2' ' NH2' ' A' ' 25' ' ' ARG . 6.8 tt0 -54.35 -51.77 63.72 Favored 'General case' 0 C--N 1.35 0.588 0 C-N-CA 126.382 1.873 . . . . 65.170000000000002 114.041 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 65.2 t -57.54 -28.42 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 113.907 -1.497 . . . . 41.479999999999997 110.753 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -75.83 -50.4 15.24 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 107.297 -1.372 . . . . 46.689999999999998 107.297 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . 0.48 ' NH2' ' OE2' ' A' ' 22' ' ' GLU . 0.6 OUTLIER -53.38 -51.72 61.61 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 114.078 -1.419 . . . . 78.700000000000003 107.207 179.294 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.95 -31.48 69.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.185 -1.37 . . . . 42.939999999999998 112.304 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . 0.479 ' O ' ' C ' ' A' ' 28' ' ' LYS 0.265 21.0 mttm -66.12 -58.25 5.88 Favored 'General case' 0 C--N 1.346 0.453 0 C-N-CA 119.234 -0.986 . . . . 58.18 112.016 179.566 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . 0.479 ' C ' ' O ' ' A' ' 27' ' ' LYS . 16.2 mttp -42.68 -47.45 5.34 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 118.722 -1.191 . . . . 99.709999999999994 108.125 178.884 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -39.37 -24.49 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.638 -1.619 . . . . 62.409999999999997 113.522 -179.397 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . 0.403 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.6 t . . . . . 0 C--O 1.239 0.535 0 CA-C-O 122.941 1.353 . . . . 100.0 111.677 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-O 121.231 0.539 . . . . 68.980000000000004 110.477 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . 0.428 0.6 OUTLIER -41.26 -62.85 0.77 Allowed 'General case' 0 C--O 1.242 0.696 1 N-CA-C 123.027 4.454 . . . . 62.890000000000001 123.027 -178.08 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LYS . . . . . 0.432 ' CD ' ' N ' ' B' ' 3' ' ' LYS . 0.8 OUTLIER -55.65 -34.11 64.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 115.047 1.499 . . . . 100.0 115.047 -178.311 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.354 77.3 mt-30 -73.23 -41.95 63.14 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 116.699 -2.0 . . . . 57.210000000000001 108.188 179.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 mt -62.4 -45.85 91.24 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 107.676 -1.231 . . . . 32.380000000000003 107.676 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -59.76 -38.15 81.0 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 114.787 -1.097 . . . . 43.539999999999999 109.58 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -68.12 -40.28 82.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 C-N-CA 125.188 1.395 . . . . 45.079999999999998 112.999 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -67.09 -33.78 76.22 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 125.16 1.538 . . . . 54.979999999999997 110.306 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 11.2 t -67.31 -53.16 35.05 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 CA-C-O 122.006 0.907 . . . . 23.100000000000001 109.838 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -63.2 -22.35 66.81 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 114.664 -1.153 . . . . 62.270000000000003 108.55 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . 0.281 84.5 mt-10 -77.48 -49.1 15.47 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 119.576 -0.849 . . . . 53.159999999999997 112.04 -179.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 23.3 mt -63.15 -44.65 94.9 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 122.63 1.205 . . . . 30.690000000000001 111.89 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 46.4 tp -56.23 -32.76 64.74 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.07 1.507 . . . . 29.379999999999999 115.07 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -31.13 43.59 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.313 0.578 . . . . 43.289999999999999 110.512 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -71.68 -33.64 69.01 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 106.414 -1.699 . . . . 100.0 106.414 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -61.28 -40.16 93.1 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 114.94 -1.027 . . . . 40.210000000000001 112.833 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.2 -37.12 80.56 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.379 0.609 . . . . 44.689999999999998 110.746 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -73.45 -29.16 62.36 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.21 1.189 . . . . 38.789999999999999 114.21 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 17.4 mt -77.91 -44.71 26.22 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 108.889 -0.782 . . . . 37.030000000000001 108.889 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -52.55 -52.55 54.33 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.089 1.355 . . . . 55.960000000000001 111.195 179.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.49 -19.86 64.56 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 122.549 1.166 . . . . 43.590000000000003 112.151 179.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.75 -52.96 20.8 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 122.843 1.306 . . . . 61.299999999999997 108.26 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 68.1 t -52.6 -57.67 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.649 0 CA-C-N 113.146 -1.843 . . . . 40.060000000000002 106.849 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -44.57 -46.09 9.79 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.086 -0.961 . . . . 48.689999999999998 111.742 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ARG . . . . . 0.628 ' NH1' ' O ' ' B' ' 54' ' ' HOH . 65.6 mtm-85 -65.36 -39.17 91.97 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 122.646 0.378 . . . . 100.0 111.445 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 10.9 mt -65.63 -38.5 89.58 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 124.93 1.292 . . . . 43.75 112.918 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.6 mttm -61.43 -37.08 82.2 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.457 0.646 . . . . 50.310000000000002 111.519 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' B' ' 30' ' ' VAL . 5.4 mtmm -65.55 -72.51 0.15 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 116.638 -2.025 . . . . 96.969999999999999 107.459 179.475 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . 0.429 ' C ' ' O ' ' B' ' 28' ' ' LYS . 6.6 tp -32.96 -33.04 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.433 1.111 . . . . 53.630000000000003 112.142 178.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . 0.504 ' N ' ' O ' ' B' ' 28' ' ' LYS . 21.0 t . . . . . 0 C--N 1.329 -0.312 0 C-N-CA 123.901 0.88 . . . . 87.140000000000001 110.396 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' HOH . . . . . 0.628 ' O ' ' NH1' ' B' ' 25' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ARG . . . . . 0.777 ' HA ' ' CD ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.171 0 N-CA-C 114.965 1.468 . . . . 73.04 114.965 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' MET . . . . . 0.657 ' HE3' ' HG3' ' B' ' 2' ' ' MET . 0.2 OUTLIER -61.04 -50.87 71.55 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 124.853 1.261 . . . . 66.94 108.552 179.928 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -61.72 -17.98 57.9 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 113.637 -1.62 . . . . 56.22 110.225 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . 0.777 ' CD ' ' HA ' ' A' ' 1' ' ' ARG . 3.6 mt-30 -83.18 -40.84 19.17 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 106.186 -1.783 . . . . 100.0 106.186 179.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 9' ' ' VAL . 16.6 mt -69.64 -37.31 76.73 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 114.649 -1.159 . . . . 24.2 109.171 -179.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.86 -47.73 82.1 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 113.803 -1.544 . . . . 24.04 110.154 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.94 -27.78 69.08 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 115.532 1.679 . . . . 37.91 115.532 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -71.58 -41.61 68.81 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.972 -1.013 . . . . 35.67 109.688 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.439 HG13 ' CD1' ' B' ' 12' ' ' LEU . 13.8 t -62.64 -46.83 95.42 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 N-CA-C 108.294 -1.002 . . . . 24.48 108.294 179.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -62.58 -39.94 95.3 Favored 'General case' 0 CA--C 1.501 -0.907 0 CA-C-N 114.897 -1.047 . . . . 53.37 111.676 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 1.6 tt0 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 115.838 -2.345 . . . . 60.93 110.985 179.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.53 -24.33 64.63 Favored 'General case' 0 C--O 1.253 1.247 0 N-CA-C 115.611 1.708 . . . . 28.47 115.611 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.11 -39.5 68.82 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 120.056 -0.657 . . . . 28.64 109.597 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.85 -38.64 88.99 Favored 'General case' 0 C--N 1.352 0.701 0 CA-C-N 114.363 -1.289 . . . . 31.96 110.768 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.5 mttm -68.67 -47.8 65.57 Favored 'General case' 0 C--O 1.206 -1.203 0 N-CA-C 107.946 -1.131 . . . . 91.06 107.946 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . 0.586 ' CD ' ' HE3' ' B' ' 15' ' ' LYS . 31.8 tt0 -52.93 -49.37 66.14 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.09 -0.959 . . . . 29.18 111.392 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.259 22.0 m-85 -58.86 -48.39 81.52 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.122 1.156 . . . . 24.75 114.122 179.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -51.87 -46.79 64.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.927 0.87 . . . . 38.76 108.961 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.5 mt -57.51 -45.31 85.1 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 113.393 -1.731 . . . . 48.24 113.362 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -70.76 -31.5 68.32 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 118.636 -1.226 . . . . 80.02 110.798 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 0.537 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 83.7 m-20 -61.81 -49.06 77.86 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 118.258 -1.377 . . . . 45.12 109.64 179.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . 0.568 ' HG3' HH21 ' A' ' 25' ' ' ARG . 6.8 tt0 -54.35 -51.77 63.72 Favored 'General case' 0 C--N 1.35 0.588 0 C-N-CA 126.382 1.873 . . . . 65.17 114.041 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . 0.467 HG22 HG22 ' B' ' 23' ' ' VAL . 65.2 t -57.54 -28.42 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 113.907 -1.497 . . . . 41.48 110.753 178.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 21' ' ' ASN . . . -75.83 -50.4 15.24 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 107.297 -1.372 . . . . 46.69 107.297 178.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . 0.568 HH21 ' HG3' ' A' ' 22' ' ' GLU . 0.6 OUTLIER -53.38 -51.72 61.61 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 114.078 -1.419 . . . . 78.7 107.207 179.294 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.538 ' CD1' HG13 ' B' ' 23' ' ' VAL . 84.5 mt -59.95 -31.48 69.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.185 -1.37 . . . . 42.94 112.304 -179.395 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . 0.479 ' O ' ' C ' ' A' ' 28' ' ' LYS 0.265 21.0 mttm -66.12 -58.25 5.88 Favored 'General case' 0 C--N 1.346 0.453 0 C-N-CA 119.234 -0.986 . . . . 58.18 112.016 179.566 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . 0.479 ' C ' ' O ' ' A' ' 27' ' ' LYS . 16.2 mttp -42.68 -47.45 5.34 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 118.722 -1.191 . . . . 99.71 108.125 178.884 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . 0.938 ' HG ' HG11 ' B' ' 30' ' ' VAL . 0.3 OUTLIER -39.37 -24.49 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.638 -1.619 . . . . 62.41 113.522 -179.397 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . 0.403 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.6 t . . . . . 0 C--O 1.239 0.535 0 CA-C-O 122.941 1.353 . . . . 100.0 111.677 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ARG . . . . . 0.582 ' C ' ' HD3' ' B' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-O 121.231 0.539 . . . . 68.98 110.477 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 2' ' ' MET . . . . . 0.657 ' HG3' ' HE3' ' A' ' 2' ' ' MET 0.428 0.6 OUTLIER -41.26 -62.85 0.77 Allowed 'General case' 0 C--O 1.242 0.696 1 N-CA-C 123.027 4.454 . . . . 62.89 123.027 -178.08 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LYS . . . . . 0.818 ' HD3' ' H ' ' B' ' 3' ' ' LYS . 0.8 OUTLIER -55.65 -34.11 64.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 115.047 1.499 . . . . 100.0 115.047 -178.311 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.354 77.3 mt-30 -73.23 -41.95 63.14 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 116.699 -2.0 . . . . 57.21 108.188 179.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 mt -62.4 -45.85 91.24 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 107.676 -1.231 . . . . 32.38 107.676 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . 0.5 ' OE2' ' HB3' ' B' ' 2' ' ' MET . 12.3 mt-10 -59.76 -38.15 81.0 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 114.787 -1.097 . . . . 43.54 109.58 178.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -68.12 -40.28 82.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 C-N-CA 125.188 1.395 . . . . 45.08 112.999 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -67.09 -33.78 76.22 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 125.16 1.538 . . . . 54.98 110.306 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 11.2 t -67.31 -53.16 35.05 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 CA-C-O 122.006 0.907 . . . . 23.1 109.838 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -63.2 -22.35 66.81 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 114.664 -1.153 . . . . 62.27 108.55 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' B' ' 64' ' ' HOH 0.281 84.5 mt-10 -77.48 -49.1 15.47 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 119.576 -0.849 . . . . 53.16 112.04 -179.82 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . 0.439 ' CD1' HG13 ' A' ' 9' ' ' VAL . 23.3 mt -63.15 -44.65 94.9 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 122.63 1.205 . . . . 30.69 111.89 179.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 46.4 tp -56.23 -32.76 64.74 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.07 1.507 . . . . 29.38 115.07 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -31.13 43.59 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.313 0.578 . . . . 43.29 110.512 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . 0.586 ' HE3' ' CD ' ' A' ' 16' ' ' GLN . 3.9 tttm -71.68 -33.64 69.01 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 106.414 -1.699 . . . . 100.0 106.414 178.571 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -61.28 -40.16 93.1 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 114.94 -1.027 . . . . 40.21 112.833 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.2 -37.12 80.56 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.379 0.609 . . . . 44.69 110.746 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -73.45 -29.16 62.36 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.21 1.189 . . . . 38.79 114.21 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 17.4 mt -77.91 -44.71 26.22 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 108.889 -0.782 . . . . 37.03 108.889 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -52.55 -52.55 54.33 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.089 1.355 . . . . 55.96 111.195 179.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASN . . . . . 0.686 ' O ' ' HG3' ' B' ' 25' ' ' ARG . 0.1 OUTLIER -68.49 -19.86 64.56 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 122.549 1.166 . . . . 43.59 112.151 179.75 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.75 -52.96 20.8 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 122.843 1.306 . . . . 61.3 108.26 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . 0.538 HG13 ' CD1' ' A' ' 26' ' ' LEU . 68.1 t -52.6 -57.67 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.649 0 CA-C-N 113.146 -1.843 . . . . 40.06 106.849 178.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -44.57 -46.09 9.79 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.086 -0.961 . . . . 48.69 111.742 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ARG . . . . . 0.686 ' HG3' ' O ' ' B' ' 21' ' ' ASN . 65.6 mtm-85 -65.36 -39.17 91.97 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 122.646 0.378 . . . . 100.0 111.445 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 10.9 mt -65.63 -38.5 89.58 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 124.93 1.292 . . . . 43.75 112.918 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.6 mttm -61.43 -37.08 82.2 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.457 0.646 . . . . 50.31 111.519 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' B' ' 30' ' ' VAL . 5.4 mtmm -65.55 -72.51 0.15 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 116.638 -2.025 . . . . 96.97 107.459 179.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . 0.429 ' C ' ' O ' ' B' ' 28' ' ' LYS . 6.6 tp -32.96 -33.04 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.433 1.111 . . . . 53.63 112.142 178.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . 0.938 HG11 ' HG ' ' A' ' 29' ' ' LEU . 21.0 t . . . . . 0 C--N 1.329 -0.312 0 C-N-CA 123.901 0.88 . . . . 87.14 110.396 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 64' ' ' HOH . . . . . 0.494 ' O ' ' HB3' ' B' ' 11' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.777 ' HA ' ' CD ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.171 0 N-CA-C 114.965 1.468 . . . . 73.040000000000006 114.965 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' MET . . . . . 0.657 ' HE3' ' HG3' ' B' ' 2' ' ' MET . 0.2 OUTLIER -61.04 -50.87 71.55 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 124.853 1.261 . . . . 66.939999999999998 108.552 179.928 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -61.72 -17.98 57.9 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 113.637 -1.62 . . . . 56.219999999999999 110.225 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.777 ' CD ' ' HA ' ' A' ' 1' ' ' ARG . 15.3 mt-30 -83.18 -40.84 19.17 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 106.186 -1.783 . . . . 100.0 106.186 179.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 9' ' ' VAL . 16.6 mt -69.64 -37.31 76.73 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 114.649 -1.159 . . . . 24.199999999999999 109.171 -179.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.86 -47.73 82.1 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 113.803 -1.544 . . . . 24.039999999999999 110.154 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.94 -27.78 69.08 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 115.532 1.679 . . . . 37.909999999999997 115.532 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -71.58 -41.61 68.81 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.972 -1.013 . . . . 35.670000000000002 109.688 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.439 HG13 ' CD1' ' B' ' 12' ' ' LEU . 13.8 t -62.64 -46.83 95.42 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 N-CA-C 108.294 -1.002 . . . . 24.48 108.294 179.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -62.58 -39.94 95.3 Favored 'General case' 0 CA--C 1.501 -0.907 0 CA-C-N 114.897 -1.047 . . . . 53.369999999999997 111.676 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 1.6 tt0 -67.85 -35.4 78.5 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 115.838 -2.345 . . . . 60.93 110.985 179.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.53 -24.33 64.63 Favored 'General case' 0 C--O 1.253 1.247 0 N-CA-C 115.611 1.708 . . . . 28.469999999999999 115.611 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.11 -39.5 68.82 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 120.056 -0.657 . . . . 28.640000000000001 109.597 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.85 -38.64 88.99 Favored 'General case' 0 C--N 1.352 0.701 0 CA-C-N 114.363 -1.289 . . . . 31.960000000000001 110.768 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.5 mttm -68.67 -47.8 65.57 Favored 'General case' 0 C--O 1.206 -1.203 0 N-CA-C 107.946 -1.131 . . . . 91.060000000000002 107.946 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.586 ' CD ' ' HE3' ' B' ' 15' ' ' LYS . 31.8 tt0 -52.93 -49.37 66.14 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.09 -0.959 . . . . 29.18 111.392 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.259 22.0 m-85 -58.86 -48.39 81.52 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.122 1.156 . . . . 24.75 114.122 179.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -51.87 -46.79 64.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.927 0.87 . . . . 38.759999999999998 108.961 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.5 mt -57.51 -45.31 85.1 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 113.393 -1.731 . . . . 48.240000000000002 113.362 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -70.76 -31.5 68.32 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 118.636 -1.226 . . . . 80.019999999999996 110.798 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.537 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 83.7 m-20 -61.81 -49.06 77.86 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 118.258 -1.377 . . . . 45.119999999999997 109.64 179.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.568 ' HG3' HH21 ' A' ' 25' ' ' ARG . 6.8 tt0 -54.35 -51.77 63.72 Favored 'General case' 0 C--N 1.35 0.588 0 C-N-CA 126.382 1.873 . . . . 65.170000000000002 114.041 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.467 HG22 HG22 ' B' ' 23' ' ' VAL . 65.2 t -57.54 -28.42 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 113.907 -1.497 . . . . 41.479999999999997 110.753 178.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 21' ' ' ASN . . . -75.83 -50.4 15.24 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 107.297 -1.372 . . . . 46.689999999999998 107.297 178.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.568 HH21 ' HG3' ' A' ' 22' ' ' GLU . 0.6 OUTLIER -53.38 -51.72 61.61 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 114.078 -1.419 . . . . 78.700000000000003 107.207 179.294 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.538 ' CD1' HG13 ' B' ' 23' ' ' VAL . 84.5 mt -59.95 -31.48 69.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.185 -1.37 . . . . 42.939999999999998 112.304 -179.395 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.479 ' O ' ' C ' ' A' ' 28' ' ' LYS 0.265 21.0 mttm -66.12 -58.25 5.88 Favored 'General case' 0 C--N 1.346 0.453 0 C-N-CA 119.234 -0.986 . . . . 58.18 112.016 179.566 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.479 ' C ' ' O ' ' A' ' 27' ' ' LYS . 16.2 mttp -42.68 -47.45 5.34 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 118.722 -1.191 . . . . 99.709999999999994 108.125 178.884 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.938 ' HG ' HG11 ' B' ' 30' ' ' VAL . 0.3 OUTLIER -39.37 -24.49 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.638 -1.619 . . . . 62.409999999999997 113.522 -179.397 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.403 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.6 t . . . . . 0 C--O 1.239 0.535 0 CA-C-O 122.941 1.353 . . . . 100.0 111.677 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.582 ' HD3' ' C ' ' B' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.535 0 CA-C-O 121.231 0.539 . . . . 68.980000000000004 110.477 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' MET . . . . . 0.657 ' HG3' ' HE3' ' A' ' 2' ' ' MET 0.428 0.6 OUTLIER -41.26 -62.85 0.77 Allowed 'General case' 0 C--O 1.242 0.696 1 N-CA-C 123.027 4.454 . . . . 62.890000000000001 123.027 -178.08 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LYS . . . . . 0.818 ' HD3' ' H ' ' B' ' 3' ' ' LYS . 0.8 OUTLIER -55.65 -34.11 64.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 115.047 1.499 . . . . 100.0 115.047 -178.311 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.354 77.3 mt-30 -73.23 -41.95 63.14 Favored 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 116.699 -2.0 . . . . 57.210000000000001 108.188 179.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 14.4 mt -62.4 -45.85 91.24 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 107.676 -1.231 . . . . 32.380000000000003 107.676 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.5 ' OE2' ' HB3' ' B' ' 2' ' ' MET . 12.3 mt-10 -59.76 -38.15 81.0 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 114.787 -1.097 . . . . 43.539999999999999 109.58 178.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -68.12 -40.28 82.56 Favored 'General case' 0 CA--C 1.505 -0.775 0 C-N-CA 125.188 1.395 . . . . 45.079999999999998 112.999 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -67.09 -33.78 76.22 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 125.16 1.538 . . . . 54.979999999999997 110.306 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 11.2 t -67.31 -53.16 35.05 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 CA-C-O 122.006 0.907 . . . . 23.100000000000001 109.838 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -63.2 -22.35 66.81 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 114.664 -1.153 . . . . 62.270000000000003 108.55 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' B' ' 64' ' ' HOH 0.281 84.5 mt-10 -77.48 -49.1 15.47 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 119.576 -0.849 . . . . 53.159999999999997 112.04 -179.82 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.439 ' CD1' HG13 ' A' ' 9' ' ' VAL . 23.3 mt -63.15 -44.65 94.9 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 122.63 1.205 . . . . 30.690000000000001 111.89 179.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 46.4 tp -56.23 -32.76 64.74 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.07 1.507 . . . . 29.379999999999999 115.07 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.22 -31.13 43.59 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.313 0.578 . . . . 43.289999999999999 110.512 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . 0.586 ' HE3' ' CD ' ' A' ' 16' ' ' GLN . 3.9 tttm -71.68 -33.64 69.01 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 106.414 -1.699 . . . . 100.0 106.414 178.571 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -61.28 -40.16 93.1 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 114.94 -1.027 . . . . 40.210000000000001 112.833 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.2 -37.12 80.56 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.379 0.609 . . . . 44.689999999999998 110.746 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -73.45 -29.16 62.36 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.21 1.189 . . . . 38.789999999999999 114.21 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 17.4 mt -77.91 -44.71 26.22 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 108.889 -0.782 . . . . 37.030000000000001 108.889 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -52.55 -52.55 54.33 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.089 1.355 . . . . 55.960000000000001 111.195 179.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.686 ' O ' ' HG3' ' B' ' 25' ' ' ARG . 0.1 OUTLIER -68.49 -19.86 64.56 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 122.549 1.166 . . . . 43.590000000000003 112.151 179.75 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -69.75 -52.96 20.8 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 122.843 1.306 . . . . 61.299999999999997 108.26 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.538 HG13 ' CD1' ' A' ' 26' ' ' LEU . 68.1 t -52.6 -57.67 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.649 0 CA-C-N 113.146 -1.843 . . . . 40.060000000000002 106.849 178.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -44.57 -46.09 9.79 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.086 -0.961 . . . . 48.689999999999998 111.742 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ARG . . . . . 0.686 ' HG3' ' O ' ' B' ' 21' ' ' ASN . 65.6 mtm-85 -65.36 -39.17 91.97 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 122.646 0.378 . . . . 100.0 111.445 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 10.9 mt -65.63 -38.5 89.58 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 124.93 1.292 . . . . 43.75 112.918 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.6 mttm -61.43 -37.08 82.2 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.457 0.646 . . . . 50.310000000000002 111.519 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' B' ' 30' ' ' VAL . 5.4 mtmm -65.55 -72.51 0.15 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 116.638 -2.025 . . . . 96.969999999999999 107.459 179.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.429 ' C ' ' O ' ' B' ' 28' ' ' LYS . 6.6 tp -32.96 -33.04 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.433 1.111 . . . . 53.630000000000003 112.142 178.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.938 HG11 ' HG ' ' A' ' 29' ' ' LEU . 21.0 t . . . . . 0 C--N 1.329 -0.312 0 C-N-CA 123.901 0.88 . . . . 87.140000000000001 110.396 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' HOH . . . . . 0.494 ' O ' ' HB3' ' B' ' 11' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_